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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 1,693 records · Page 94
All sourcesNASA NTRSDOE OSTI
DOE OSTI2015

Investigations on Ni-Co-Mn-Sn thin films: Effect of substrate temperature and Ar gas pressure on the martensitic transformations and exchange bias properties

We report the effect of substrate temperature (T{sub S}) and Ar gas pressure (P{sub D}) on the martensitic transformations, magnetic and exchange bias (EB) properties in Heusler type Ni-Co-Mn-Sn epitaxial thin films. Martensitic transformation temperatures and EB fields at 5 K were found to increase with increasing T{sub S}. The observed maximum EB value of 320 Oe after field cooling in the film deposited at 650 {sup ∘}C is high among the values reported for Ni-Mn-Sn thin films which is attributed to the coexistence of ferromagnetic (FM) and antiferromagnetic (AF) phases in the martensitic state. In the case of P{sub D} variation, with increase in P{sub D}, martensitic transformation temperatures were increased and a sharp transformation was observed in the film deposited at 0.06 mbar. Magnetization values at 5 K were higher for increasing P{sub D}. These observations are attributed to the compositional shift. EB effect is also present in these films. Microstructural features observed using atomic force microscopy (AFM) shows a fine twinning and reduced precipitation with increase in P{sub D}, which is also confirmed from the scanning electron microscopy (SEM) images. EB effects in both series were confirmed from the training effect. Target ageing effect has been observed in the films deposited before and after ninety days of time interval. This has been confirmed both on substrate temperature and Ar gas pressure variations.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Effects of strain and defects on the topological properties of HfTe 5

Manipulating topological states is a topic of vigorous research. However, the impact of such topological phase transitions on the quasiparticle dynamics remains elusive. Here, in this work, we present the effects of a transition from a strong to weak topological insulator in HfTe 5 as a function of Te vacancy concentration. We observed a significant transition from distinct sharp surface states and Dirac crossing to a Fermi-liquid-like quasiparticle state in which these surface-localized features are heavily suppressed. Additionally, by inducing the same effect through applied uniaxial stress, we demonstrate that changes in the lattice constants play the foremost role in determining the electronic structure, self-energy, and topological states of HfTe 5 . Our results demonstrate the possibility of using both defect chemistry and strain as control parameters for topological phase transitions and associated many-body physics.

36 MATERIALS SCIENCE↗
NASA NTRS1989

Galaxy formation by dust

It has been known since the early 1940's that radiation can cause an instability in the interstellar medium. Absorbing dust particles in an isotropic radiation field shadow each other by a solid angle which is inversely proportional to the square of the distance between the two particles, leading to an inverse-square attractive force - mock gravity. The effect is largest in an optically thin medium. Recently Hogan and White (HW, hereafter) proposed that if the pre-galactic universe contained suitable sources of radiation and dust, instability in the dust distribution caused by mock gravity may have led to the formation of galaxies and galaxy clusters. In their picture of a well-coupled dust-gas medium, HW show that mock gravity begins to dominate gravitational instability when the perturbation becomes optically thin, provided that the radiation field at the time is strong enough. The recent rocket observation of the microwave background at submillimeter wavelengths by Matsumoto et al. might be from pre-galactic stars, the consequence of the absorption of ultraviolet radiation by dust, and infrared reemission which is subsequently redshifted. HW's analysis omits radiative drag, incomplete collisional coupling of gas and dust, finite dust albedo, and finite matter pressure. These effects could be important. In a preliminary calculation including them, the authors have confirmed that mock gravitational instability is effective if there is a strong ultraviolet radiation at the time, but any galaxies that form would be substantially enriched in heavy elements because the contraction of the dust is more rapid than that of the gas. Moreover, since the dust moves with supersonic velocity through the gas soon after the perturbation becomes optically thin, the sputtering of dust particles by gas is significant, so the dust could disappear before the instability develops significantly. They conclude that the mock gravity by dust is not important in galaxy formations.

Wang, Boqi↗
NASA NTRS1992

Departure solutions of the unsteady thin-layer and full Navier-Stokes equations solved using streamline curvature based iteration techniques

The development of a thorough understanding of the mechanisms for vortex eruptions from viscous layers, which are believed to be associated with phenomena such as dynamic stall onset and transition, is crucial if accurate models of such phenomena are to be formulated. The development of such models may, in turn, allow for the possibility that such effects could be accounted for during the design of various aerodynamic devices such as wings, helicopter rotors, and turbomachinery blading and thus lead to designs which are stall free or stall resistant and which have better stall-recovery properties. The present investigation is being conducted as part of an effort to develop analytical and numerical tools which can be used to help improve our understanding of the vortex-eruption mechanism at high Reynolds numbers. The addition of the normal-momentum equation to the classical unsteady boundary-layer equations is crucial according to recent asymptotic analyses of the vortex-eruption problem and is a key feature of the analyses being developed by the present authors. The purpose of this paper is as follows: to describe departure solution behavior observed when using unsteady, streamline-curvature based solution procedures in which nontrivial transverse pressure gradient effects are included; and to show that special treatment of the time-derivative of the normal velocity is needed to eliminate the ill-posed solution behavior, which is observed when small spatial and temporal step sizes are used.

Barnett, M.↗
NASA NTRS2005

Validation of AIRS/AMSU Cloud Retrievals Using MODIS Cloud Analyses

The AIRS/AMSU (flying on the EOS-AQUA satellite) sounding retrieval methodology allows for the retrieval of key atmospheric/surface parameters under partially cloudy conditions (Susskind et al.). In addition, cloud parameters are also derived from the AIRS/AMSU observations. Within each AIRS footprint, cloud parameters at up to 2 cloud layers are determined with differing cloud top pressures and effective (product of infrared emissivity at 11 microns and physical cloud fraction) cloud fractions. However, so far the AIRS cloud product has not been rigorously evaluated/validated. Fortunately, collocated/coincident radiances measured by MODIS/AQUA (at a much lower spectral resolution but roughly an order of-magnitude higher spatial resolution than that of AIRS) are used to determine analogous cloud products from MODIS. This allows us for a rather rare and interesting possibility: the intercomparisons and mutual validation of imager vs. sounder-based cloud products obtained from the same satellite positions. First, we present results of small-scale (granules) instantaneous intercomparisons. Next, we will evaluate differences of temporally averaged (monthly) means as well as the representation of inter-annual variability of cloud parameters as presented by the two cloud data sets. In particular, we present statistical differences in the retrieved parameters of cloud fraction and cloud top pressure. We will investigate what type of cloud systems are retrieved most consistently (if any) with both retrieval schemes, and attempt to assess reasons behind statistically significant differences.

Molnar, Gyula I.↗
NASA NTRS1959

Use of a Stanton Tube for Skin-Friction Measurements

A small total-pressure tube resting against a flat-plate surface was used as a Stanton tube and calibrated as a skin-friction meter at various subsonic and supersonic speeds. Laminar flow was maintained for the supersonic runs at a Mach number M(sub infinity) of 2. At speeds between M(sub infinity) = 1.33 and M(sub infinity) = 1.87, the calibrations were carried-out in a turbulent boundary layer. The subsonic flows were found to be in transition. The skin-friction readings of a floating-element type of balance served as the reference values against which the Stanton tube was calibrated. A theoretical model was developed which, for moderate values of the shear parameter tau, accurately predicts the performance of the Stanton tube in subsonic and supersonic flows. A "shear correction factor" was found to explain the deviations from the basic model when T became too large. Compressibility effects were important only in the case of turbulent supersonic flows, and they did not alter the form of the calibration curve. The test Reynolds numbers, based on the distance from the leading edge and free-stream conditions, ranged from 70,000 to 875,000. The turbulent-boundary-layer Reynolds numbers, based on momentum thickness, varied between 650 and 2,300. Both laminar and turbulent velocity profiles were taken and the effect of pressure gradient on the calibration was investigated.

Abarbanel, S. S.↗
DOE OSTI2018

Structural, electronic, vibrational, and elastic properties of graphene/ MoS 2 bilayer heterostructures

Graphene/MoS 2 van der Waals (vdW) heterostructures have promising technological applications due to their unique properties and functionalities. Many experimental and theoretical research groups across the globe have made outstanding contributions to benchmark the properties of graphene/MoS 2 heterostructures. Even though some research groups have modeled the graphene/MoS 2 heterostructures using first-principles calculations, there exist several discrepancies in the results from different theoretical research groups and the experimental findings. In the present work, we revisit this problem by means of first-principles calculations and address the existing discrepancies about the interlayer spacing between graphene and MoS 2 monolayers in graphene/MoS 2 heterostructures and about the location of Dirac points near the Fermi level. We further investigate the electronic, mechanical, and vibrational properties of the optimized graphene/MoS 2 heterostructures created using 5 x 5/4 x 4 and 4 x 4/3 x 3 supercell geometries having different magnitudes of lattice mismatch. The effect of the varying interlayer spacing on the electronic properties of heterostructures is discussed. Our phonon calculations reveal that the interlayer shear and breathing phonon modes, which are very sensitive to the weak vdW interactions, play a vital role in describing the thermal properties of the studied systems. The thermodynamic and elastic properties of heterostructures are further discussed. A systematic comparison between our results and the results reported from other research groups is presented.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2020

High-temperature ion-thermal behavior from average-atom calculations

Atom-in-jellium calculations of the Einstein frequency were used to calculate the mean displacement of an ion over a wide range of compression and temperature. Expressed as a fraction of the Wigner-Seitz radius, the displacement is a measure of the asymptotic freedom of the ion at high temperature, and thus of the change in heat capacity from six to three quadratic degrees of freedom per atom. A functional form for free energy was proposed based on the Maxwell-Boltzmann distribution as a correction to the Debye free energy, with a single free parameter representing the effective density of potential modes to be saturated. Finally, this parameter was investigated using molecular dynamics simulations, and found to be ~0.2 per atom. In this way, the ion-thermal contribution can be calculated for a wide-range equation of state (EOS) without requiring a large number of molecular dynamics simulations. Example calculations were performed for carbon, including the sensitivity of key EOS loci to ionic freedom.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2020

Anharmonic phonon damping enhances the T c of BCS-type superconductors

In this study, a theory of superconductivity is presented where the effect of anharmonicity, as entailed in the acoustic, or optical, phonon damping, is explicitly considered in the pairing mechanism. The gap equation is solved including diffusive Akhiezer damping for longitudinal acoustic phonons or Klemens damping for optical phonons, with a damping coefficient which, in either case, can be directly related to the Grüneisen parameter and hence to the anharmonic coefficients in the interatomic potential. The results show that the increase of anharmonicity has a strikingly nonmonotonic effect on the critical temperature T c . The optimal damping coefficient yielding maximum T c is set by the velocity of the bosonic mediator. This theory may open up unprecedented opportunities for material design where T c may be tuned via the anharmonicity of the interatomic potential, and presents implications for the superconductivity in the recently discovered hydrides, where anharmonicity is very strong and for which the anharmonic damping is especially relevant.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2022

Engineering Interlayer Electron–Phonon Coupling in WS 2 /BN Heterostructures

In van der Waals (vdW) heterostructures, the interlayer electron–phonon coupling (EPC) provides one unique channel to nonlocally engineer these elementary particles. However, limited by the stringent occurrence conditions, the efficient engineering of interlayer EPC remains elusive. Here we report a multitier engineering of interlayer EPC in WS2/boron nitride (BN) heterostructures, including isotope enrichments of BN substrates, temperature, and high-pressure tuning. The hyperfine isotope dependence of Raman intensities was unambiguously revealed. In combination with theoretical calculations, we anticipate that WS2/BN supercells could induce Brillouin-zone-folded phonons that contribute to the interlayer coupling, leading to a complex nature of broad Raman peaks. We further demonstrate the significance of a previously unexplored parameter, the interlayer spacing. By varying the temperature and high pressure, we effectively manipulated the strengths of EPC with on/off capabilities, indicating critical thresholds of the layer–layer spacing for activating and strengthening interlayer EPC. Our findings provide new opportunities to engineer vdW heterostructures with controlled interlayer coupling.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
NASA NTRS1978

Workbook for estimating effects of accidental explosions in propellant ground handling and transport systems

A workbook is presented to supplement an earlier NASA publication, which was intended to provide the designer and safety engineer with rapid methods for predicting damage and hazards from explosions of liquid propellant and compressed gas vessels used in ground storage, transport and handling. Information is presented in the form of graphs and tables to allow easy calculation, using only desk or handheld calculators. Topics covered in various chapters are: (1) estimates of explosive yield; (2) characteristics of pressure waves; (3) effects of pressure waves; (4) characteristics of fragments; and (5) effects of fragments and related topics.

Baker, W. E.↗
NASA NTRS1996

Mechanics of Granular Materials (MGM)

The constitutive behavior of uncemented granular materials such as strength, stiffness, and localization of deformations are to a large extend derived from interparticle friction transmitted between solid particles and particle groups. Interparticle forces are highly dependent on gravitational body forces. At very low effective confining pressures, the true nature of the Mohr envelope, which defines the Mohr-Coulomb failure criterion for soils, as well as the relative contribution of each of non-frictional components to soil's shear strength cannot be evaluated in terrestrial laboratories. Because of the impossibility of eliminating gravitational body forces on earth, the weight of soil grains develops interparticle compressive stresses which mask true soil constitutive behavior even in the smallest samples of models. Therefore the microgravity environment induced by near-earth orbits of spacecraft provides unique experimental opportunities for testing theories related to the mechanical behavior of terrestrial granular materials. Such materials may include cohesionless soils, industrial powders, crushed coal, etc. This paper will describe the microgravity experiment, 'Mechanics of Granular Materials (MGM)', scheduled to be flown on Space Shuttle-MIR missions. The paper will describe the experiment's hardware, instrumentation, specimen preparation procedures, testing procedures in flight, as well as a brief summary of the post-mission analysis. It is expected that the experimental results will significantly improve the understanding of the behavior of granular materials under very low effective stress levels.

Alshibli, Khalid A.↗
DOE OSTI2020

Direct time-resolved detection and quantification of key reactive intermediates in diethyl ether oxidation at T = 450–600 K

High-pressure multiplexed photoionization mass spectrometry (MPIMS) with tunable vacuum ultraviolet (VUV) ionization radiation from the Lawrence Berkeley Labs Advanced Light Source is used to investigate the oxidation of diethyl ether (DEE). Kinetics and photoionization (PI) spectra are simultaneously measured for the species formed. Several stable products from DEE oxidation are identified and quantified using reference PI cross-sections. In addition, we directly detect and quantify three key chemical intermediates: peroxy (ROO˙), hydroperoxyalkyl peroxy (˙OOQOOH), and ketohydroperoxide (HOOP[double bond, length as m-dash]O, KHP). These intermediates undergo dissociative ionization (DI) into smaller fragments, making their identification by mass spectrometry challenging. Furthermore, with the aid of quantum chemical calculations, we identify the DI channels of these key chemical species and quantify their time-resolved concentrations from the overall carbon atom balance at T = 450 K and P = 7500 torr. This allows the determination of the absolute PI cross-sections of ROO˙, ˙OOQOOH, and KHP into each DI channel directly from experiment. The PI cross-sections in turn enable the quantification of ROO˙, ˙OOQOOH, and KHP from DEE oxidation over a range of experimental conditions that reveal the effects of pressure, O 2 concentration, and temperature on the competition among radical decomposition and second O 2 addition pathways.

42 ENGINEERING↗
NASA NTRS1994

The effect of wave-particle interactions on the polar winds O(+)

The escape of the polar wind plasma is an important element in the ionosphere-magnetosphere coupling. Both theory and observations indicate that the wave-particle interactions (WPI) play a significant role in the dynamics of ion outflow along open geomagnetic field lines. A Monte Carlo simulation was developed in order to include the effect of the WPI in addition to the factors that are traditionally included in the 'classical' polar wind (i.e. gravity, electrostatic field, and divergence of geomagnetic field lines). The ion distribution function (f(sub j)), as well as the profiles of its moments (density, drift velocity, temperature, etc.) were found for different levels of WPI, that is, for different values of the normalized diffusion rate in the velocity space (D(tilde) (sub j perpendicular). Although the model included O(=), H(+) and eletrons, we presented only the results related to the O(+) ion. We found that (1) both the density and drift velocity of O(+) increased with the WPI strength, and consequently, the O(+) escape flux was enhanced by a factor of up to 10(exp 5), (2) The O(+) ions could be energized up to a few electron volts; (3) for moderate and high levels of WPI D(tilde) (sub perpendicular) (O(+) greater than (tilde) 1, the distribution function f(O(+)) displayed very pronounced conic features at altitudes around 3 R(sub e). Finally, the interplay between the downward body force, the upward mirror force, and the perpendicular heating resulted in the formation of the 'pressure cooker' effect. This phenomena explained some interesting features of our solution, such as, the peak in the O(=) temperature, and the formation of 'ears' and conics for f(O(+)) around 2.5 R(sub e).

Barakat, A. R.↗
DOE OSTI2020

The Effects of Contaminant-Aging on Decontamination Efficacy for Rapid Remediation of Concrete Surfaces - 20412

Understanding the relationship between decontamination efficacy and contaminant aging is imperative for developing effective remediation strategies following a large-scale contamination event. Non-destructive decontamination of concrete following a contamination incident becomes more difficult with increased time between contamination and decontamination because contaminants may chemically bind to concrete and/or penetrate into the concrete subsurface. In this work, we evaluated the decontamination efficacy of two decontamination methods on concrete samples contaminated with soluble Cesium-137 (Cs-137) and silica particles with 0.5 μm and 2 μm diameters. Concrete samples were aged between 1 and 59 days, with half of the coupons receiving 1 mL of artificial rainwater about once every three days. After aging, coupons were either decontaminated or analyzed to determine contaminant penetration depths. Coupons were decontaminated with 0.1 M Potassium Chloride (KCI) solution applied either by flowing solution across the contaminated coupon face or non-destructive power washing. Contaminant depth profiles were created by removing the top surface of the coupon at least 15 times, measuring the activity in each removed layer, normalizing the total activity removed to the measured decontamination efficacy following the last layer removal, and determining the penetration thickness using the coupon dimensions, bulk density, and mass of material removed for each layer. Pressurized washing effectively removed particles, but not soluble cesium, despite the majority of Cs-137 being located within the first millimeter of the subsurface. Soluble cesium removal by flowing 0.1 M KCI solution across the contaminated surface dropped to less than 12% within the first ten days. This drop in Cs-137 removal efficacy occurred within the first five days for coupons experiencing artificial rainfall events. Flowing 0.1 M KCI solution across the contaminated face was ineffective at removing particles, likely because particles had localized in surface depressions. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2016

Measurement of Void Fraction Distribution in Steam-Water Two-Phase Flow in a 44 Bundle at 2 MPa

To contribute to the clarification of the Fukushima Daiichi Accident, JAEA is working on getting instantaneous void fraction distribution data in steam-water two-phase flow in rod bundle geometry under high pressure, high temperature condition, with using Wire Mesh Sensor (WMS) developed at JAEA for high pressure, high temperature condition (Up to 2.8 MPa, 230 deg. C), focusing on the low flow rate condition after the reactor scram. The data is expected to be used in the validation of the detailed two-phase flow codes TPFIT and ACE3D developed at JAEA. The time and space averaged void fraction data is also expected being used in the validation of the drift-flux models implemented in the two fluids codes, such as TRACE code. We are still in the middle of the data analyses and here we only report a part of the results. For the present bundle rod geometry, the void fraction shows easily gathered at the center area surrounded by 4 rods and the void fraction in the sub - channels between two adjacent rods are low. Under the same steam vapor flow rate condition, void faction increase with the decrease of the water flow rate. Under the same water flow rate, the void fraction increases with the increase of the steam vapor flow rate. In recent future, we will perform more experiments under further low water flow rate condition, including stagnation condition, to confirm this changing tendency. In the present experimental range, no effect of pressure on void fraction was observed. A 3-layer WMS, with a vertical distance between the adjacent layers of 1.3 mm, was used to measure the local instantaneous void fraction in this research. By using the correlation coefficient method, we can determine the time delay between the bubble detections from the upper and the lower layer sensors. Then the speed of the bubble, and its length, can be calculated. We are working on the establishment of the databank for the slug-churn bubbles information. (authors)

42 ENGINEERING↗
DOE OSTI2023

Biphasic Janus Particles Explain Self-Healing in Pt–Pd Diesel Oxidation Catalysts

The addition of Pd to Pt-based diesel oxidation catalysts is known to enhance performance and restrict the anomalous growth of Pt nanoparticles when subjected to aging at high temperatures in oxidative environments. To gain a mechanistic understanding, we studied the transport of the mobile Pt and Pd species to the vapor phase, since vapor phase transport is the primary route for sintering in these catalysts. The results are surprising: there is a 30-fold drop in the effective vapor pressure of Pt in the Pt-Pd catalysts compared to monometallic Pt. At the same time, there is a significant enhancement in the vapor pressure of Pd, compared to PdO, which otherwise has a negligible vapor pressure at the aging temperature. Such behavior cannot be explained simply by alloying Pt and Pd in the metallic phase, or a core-shell morphology where a PdO shell covers a Pt core. Transmission electron microscopic examination of catalysts aged up to 50 h in air at 800 °C shows that the particles exhibit a biphasic “Janus”-like structure. The metal and oxide phases are conjoined, exposing a metal and an oxide face to the gas phase. The high mobility of the Pt and Pd allows them to be partitioned into the metal and oxide phases, in apparent thermodynamic equilibrium. The PdO helps to trap mobile PtO2 and as a result contains high concentrations of Pt oxide, consistent with its role in mitigating the transport of Pt to the vapor phase and preventing the growth of anomalously large particles. In turn, Pt allows Pd to remain metallic, allowing the catalyst to retain both metal and oxide functionality for catalysis. The regeneration of deactivated catalysts typically requires an external input, such as a change in the working environment from reducing to oxidizing or vice-versa. Here, we show that the mobile species, which are primary contributors to catalyst sintering are effectively returned to the active site, hence our use of the term “selfhealing”. The detailed insights into the inner workings of the Pt-Pd diesel oxidation catalysts can help provide clues to the design of robust and durable heterogeneous catalysts.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Large response of charge stripes to uniaxial stress in La 1.475 Nd 0.4 Sr 0.125 CuO 4

The La-based "214"cuprates host several symmetry-breaking phases, including superconductivity, charge and spin order in the form of stripes, and a structural orthorhombic-to-tetragonal phase transition. Therefore these materials are an ideal system to study the effects of uniaxial stress onto the various correlations that pervade the cuprate phase diagram. We report resonant x-ray scattering experiments on La 1.475 Nd 0.4 Sr 0.125 CuO 4 (LNSCO-125) that reveal a significant response of charge stripes to uniaxial tensile stress of ~0.1GPa. These effects include a reduction of the onset temperature of stripes by ~50K, a 29-K reduction of the low-temperature orthorhombic-to-tetragonal transition, competition between charge order and superconductivity, and a preference for stripes to form along the direction of applied stress. Altogether, we observe a dramatic response of the electronic properties of LNSCO-125 to a modest amount of uniaxial stress.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗